0371-0007 Screening compound: 5-nitrobenzene-1,3-dicarbonitrile

0371-0007 Screening compound: 5-nitrobenzene-1,3-dicarbonitrile
0371-0007 Screening compound: 5-nitrobenzene-1,3-dicarbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 0371-0007
5-nitrobenzene-1,3-dicarbonitrile

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

0371-0007

Molecular Formula

C8H3N3O2 (C8 H3 N3 O2)

Compound Name

5-nitrobenzene-1,3-dicarbonitrile

IUPAC name

5-nitrobenzene-13-dicarbonitrile

SMILES

N#Cc1cc([N+]([O-])=O)cc(C#N)c1

InChI

InChI=1S/C8H3N3O2/c9-4-6-1-7(5-10)3-8(2-6)11(12)13/h1-3H

InChI Key

YFNQLBUHVOIDIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00223486

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

173.13

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.525

Distribution Coefficient, logD

1.525

Water Solubility, LogSw

-1.60

Polar Surface Area

67.732

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-10.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 0371-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0371-0007?
Check Price and Availability of 0371-0007, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0371-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0371-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0371-0007
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 0371-0007 available by request